GdSb

GdSb is a stable metallic binary compound consisting of gadolinium and antimony used in materials science research.

GdSb
Crystal structure of GdSb (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

About GdSb

GdSb is a metallic compound formed from the rare-earth element gadolinium and the metalloid antimony. As a thermodynamically stable phase located on the convex hull, it represents a robust structural arrangement that has been extensively characterized across multiple crystallographic databases. Its electronic nature as a metal makes it a subject of interest for fundamental condensed matter research. The material is primarily utilized in experimental physics to explore magnetic and electronic phenomena inherent to rare-earth pnictides.

At a glance

Key Properties

Cross-validated computational properties for GdSb, aggregated across 5 databases.

Band Gap

1.45 eV
Range across DFT structures · ground state: metal

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

Stable
3 DFT sources

Structures

29
5 databases, 6 space groups
Validation

Cross-Source DFT Agreement

How well independent DFT databases agree on the thermodynamics of GdSb. Tight agreement means computed properties can be trusted without re-running calculations.

Agreement Score

1.00 / 1.00
Trust tier: medium

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

2
materials_project, oqmd

Space Group Consensus

—
Crystallography

Reported Structures

Lowest-energy structures reported for GdSb, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
——0.000.0000-1.165—
Fm-3m (No. 225)cubic0.000.0000-35.8887.51
——0.000.0000-1.165—
——0.000.0027-1.162—
——0.000.2355-0.930—
——0.000.2880-0.877—
——0.000.3320-0.833—
——0.000.4040-0.761—
——1.450.5569-0.608—
Cmcm (No. 63)orthorhombic———7.97
P-1 (No. 2)triclinic———6.04
P-1 (No. 2)triclinic———5.64
Uses

Applications

Where GdSb is used.

Condensed matter physics researchMagnetic property studiesElectronic structure investigation
Reference

Frequently Asked Questions

Common questions about GdSb, answered from cross-validated data.

What is GdSb?

GdSb is a stable metallic binary compound consisting of gadolinium and antimony used in materials science research.

More questions
What is GdSb used for?
GdSb is used in condensed matter physics research, magnetic property studies, and electronic structure investigation.
What is the band gap of GdSb?
GdSb has a DFT-computed band gap of 1.45 eV across 29 reported structures. Standard DFT underestimates band gaps, so the measured gap is typically larger.
Is GdSb a metal, semiconductor, or insulator?
DFT predicts a band gap of up to 1.45 eV (a semiconductor). Measured gaps are typically larger.
Is GdSb thermodynamically stable?
Yes — GdSb sits on the convex hull (energy above hull 0 eV/atom), i.e. stable.
What is the crystal structure of GdSb?
The reference structure of GdSb is cubic symmetry, space group Fm-3m (No. 225).
What is the density of GdSb?
The computed density of the ground-state structure of GdSb is 7.51 g/cm³.
How many polymorphs of GdSb are known?
29 structures of GdSb are reported across 5 databases, spanning 6 distinct space groups.
What elements does GdSb contain?
GdSb contains Gd and Sb (2 elements).
Where does the data for GdSb come from?
GdSb data is cross-referenced from oqmd, materials_project, alexandria, mpaloe.
Comparison

How It Compares

As a stable metallic pnictide, GdSb serves as a foundational reference point for understanding the behavior of rare-earth antimonides. It represents a well-defined structural archetype within the broader family of binary rare-earth intermetallics, providing a baseline for investigating how the localized magnetic moments of gadolinium interact with the conduction electrons in a metallic lattice.

Data sources & attribution
  • oqmd — Data from the OQMD (oqmd.org). Cite: Saal et al., JOM 65, 1501 (2013); Kirklin et al., npj Comp. Mater. 1, 15010 (2015). (CC-BY-4.0)
  • materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)
  • alexandria — Data from Alexandria. Cite: Schmidt et al., npj Comput. Mater. 10, 200 (2024). (CC-BY-4.0)
  • mpaloe — Data from MP-ALOE. Cite: Kuner et al., npj Comput. Mater. (2025), doi:10.1038/s41524-025-01834-9.

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